7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one
Basic information
- CAS
6154-35-4- Standard SMILES
CCCc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12- InChIKey
YHOXNAMTLZDCMH-UHFFFAOYSA-N- Molecular formula
- C19H17ClO3
- Average molar mass
- 328.8 g/mol
- Monoisotopic mass
- 328.0866221
Names & identifiers
- Preferred name
- 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one
- IUPAC
- 7-[(3-chlorophenyl)methoxy]-4-propylchromen-2-one
Names & synonyms
7-[(3-chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one6154-35-47-[(3-Chlorophenyl)methoxy]-4-propyl-2H-1-benzopyran-2-oneCBMicro_031067MixCom6_001371Oprea1_2088527-[(3-chlorophenyl)methoxy]-4-propylchromen-2-oneDTXSID00977107AKOS001633061BIM-0031254.P001EU-0006138SR-01000444444
Show more names
SR-01000444444-1
Database identifiers
- CAS
6154-35-4- PubChem CID
- 701601
- DTXSID
DTXSID00977107
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
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Compound notes
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